C,1,23.85,s,
C,2,47.4,s,
C,3,23.85,s,
C,4,,,
O,5,,,
C,6,35.23,s,
C,7,38.1,s,
C,8,37.04,s,
C,9,14.13,s,
C,10,55.0,s,
C,11,19.43,s,
C,12,33.2,s,
C,13,40.5,s,
C,14,16.58,s,
C,15,47.3,s,
C,16,24.3,s,
C,17,125.1,s,
C,18,140.9,s,
C,19,45.2,s,
C,20,42.26,s,
C,21,42.45,s,
C,22,25.73,s,
C,23,182.23,s,
O,24,,,
O,25,,,
C,26,42.83,s,
C,27,76.5,s,
O,28,,,
C,29,41.75,s,
C,30,10.65,s,
C,31,26.6,s,
C,32,25.1,s,
C,33,39.7,s,
C,34,24.9,s,
H,35,1.07,s,
H,36,1.07,s,
H,37,1.07,s,
H,38,1.07,s,
H,39,1.07,s,
H,40,1.07,s,
H,41,2.57,ddd,"15.4,10.4,8.1"
H,42,2.57,ddd,"15.4,8.9,1.3"
H,43,1.72,ddd,"12.4,8.1,1.3"
H,44,1.72,ddd,"12.4,10.4,8.9"
H,45,1.15,s,
H,46,1.15,s,
H,47,1.15,s,
H,48,1.3,dd,"8.8,7.9"
H,49,1.5,m,
H,50,1.5,m,
H,51,1.42,ddd,"12.4,9.9,7.8"
H,52,1.42,ddd,"12.4,10.5,1.7"
H,53,1.08,s,
H,54,1.08,s,
H,55,1.08,s,
H,56,1.63,dd,"12.6,2.3"
H,57,1.93,ddd,"15.4,5.6,2.3"
H,58,1.93,ddd,"15.4,12.6,2.6"
H,59,5.48,dd,"5.6,2.6"
H,60,2.94,dd,"13.4,4.1"
H,61,2.04,dd,"13.4,12.4"
H,62,2.04,dd,"12.4,4.1"
H,63,1.2,s,
H,64,1.2,s,
H,65,1.2,s,
H,66,,,
H,67,2.1,dd,"12.4,9.9"
H,68,2.1,dd,"12.4,1.8"
H,69,4.12,dd,"9.9,1.8"
H,70,,,
H,71,1.13,s,
H,72,1.13,s,
H,73,1.13,s,
H,74,1.72,ddd,"13.3,12.4,3.0"
H,75,1.72,ddd,"12.4,3.6,2.5"
H,76,1.61,ddd,"12.4,3.6,3.0"
H,77,1.61,ddd,"13.3,12.4,2.5"
H,78,1.31,s,
H,79,1.31,s,
H,80,1.31,s,
